Vitas-M small molecule compound
ethyl 2-[1-(4-fluorophenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-1,3-benzothiazole-6-carboxylate
Catalog ID
STK587169
SMILES CCOC(=O)c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)F)c(=O)c1c(o2)cccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H17FN2O5S MW 500.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17FN2O5S/c1-2-34-26(33)15-9-12-18-20(13-15)36-27(29-18)30-22(14-7-10-16(28)11-8-14)21-23(31)17-5-3-4-6-19(17)35-24(21)25(30)32/h3-13,22H,2H2,1H3InChIKey
ZPKLOBAIYJIVAC-UHFFFAOYSA-NSynonyms
874456-67-4874456674
CCOC(=O)C1=CC2=C(C=C1)N=C(S2)N3C(C4=C(C3=O)OC5=CC=CC=C5C4=O)C6=CC=C(C=C6)F
ETHYL2(1(4FLUOROPHENYL)39DIOXO1HCHROMENO(23C)PYRROL2YL)13BENZOTHIAZOLE6CARBOXYLATE
ethyl2(1(4fluorophenyl)39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)13benzothiazole6carboxylate
ETHYL2(1(4FLUOROPHENYL)39DIOXOCHROMENO(23C)3PYRROLIN2YL)BENZOTHIAZOLE6CARBOXYLATE
ethyl2(1(4fluorophenyl)39dioxochromeno(23c)pyrrol2(1H3H9H)yl)benzo(d)thiazole6carboxylate
InChI=1SC27H17FN2O5Sc123426(33)159121820(1315)3627(2918)3022(1471016(28)11814)2123(31)17534619(17)3524(21)25(30)32h31322H2H21H3
MFCD06591727
ZINC000002433645
ZINC000002433647
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